(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-methyl-(thiophen-2-ylmethyl)azanium

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-methyl-(thiophen-2-ylmethyl)azanium Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl-methyl-(2-thienylmethyl)ammonium CAS Name: (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl-methyl-(thiophen-2-ylmethyl)ammonium IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl-methyl-(thiophen-2-ylmethyl)azanium Traditional Name: (2-keto-6,7-dimethyl-chromen-4-yl)methyl-methyl-(2-thenyl)ammonium Formula: C18H20NO2S+ MolecularWeight: 314.4219

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH+](C)CC3=CC=CS3)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH+](C)CC3=CC=CS3)C

InChI

InChI=1S/C18H19NO2S/c1-12-7-16-14(9-18(20)21-17(16)8-13(12)2)10-19(3)11-15-5-4-6-22-15/h4-9H,10-11H2,1-3H3/p+1